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Basic Information
CAS No.: 302-40-9
Name: Benactyzine
Molecular Structure:
Molecular Structure of 302-40-9 (Benactyzine)
Formula: C20H25NO3
Molecular Weight: 327.423
Synonyms: Benzilicacid, 2-(diethylamino)ethyl ester (6CI,8CI);Ethanol, 2-diethylamino-,benzilate (4CI);2-Diethylaminoethyl benzilate;Benactyzin;Diethylaminoethyl benzilate;b-Diethylaminoethyl benzilate;
EINECS: 206-123-8
Density: 1.116 g/cm3
Melting Point: 51°
Boiling Point: 409.346 °C at 760 mmHg
Flash Point: 201.365 °C
Hazard Symbols: T
Risk Codes: 23/24/25
Safety: 36/37/39-45
PSA: 49.77000
LogP: 2.80750
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Chemistry

Product Name: Diethylaminoethyl benzilate (CAS NO.302-40-9)


Molecular Formula: C20H25NO3
Molecular Weight: 327.42g/mol
Mol File: 302-40-9.mol
Einecs: 206-123-8
Appearance: Crystals
Melting Point: 51ºC
Boiling point: 409.3 °C at 760 mmHg
Flash Point: 201.4 °C
Density: 1.115 g/cm3
Water Solubility: Solubility in water (25°): 14.9/100 mL
Surface Tension: 43.9 dyne/cm
Enthalpy of Vaporization: 69.75 kJ/mol
Vapour Pressure: 1.96E-07 mmHg at 25°C
XLogP3-AA: 2.6
H-Bond Donor: 1
H-Bond Acceptor: 4

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
human TDLo intramuscular 100ug/kg (0.1mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE "Possible Long-Term Health Effects of Short-Term Exposure to Chemical Agents," National Research Council, 3 vols., Washington, DC, National Academy Press, 1982-85Vol. 1, Pg. L1, 1982.
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Bollettino Chimico Farmaceutico. Vol. 111, Pg. 293, 1972.
 
mouse LD50 subcutaneous 159mg/kg (159mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Russian Pharmacology and Toxicology Vol. 32, Pg. 311, 1969.
rat LD50 intramuscular 135mg/kg (135mg/kg)   National Technical Information Service. Vol. AD-A099-745,

Safety Profile

Poison by subcutaneous, intramuscular, and intraperitoneal routes. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.

Specification

 Diethylaminoethyl benzilate ,its CAS NO. is 302-40-9,the synonyms is 2-Diethylaminoethyl 2-hydroxy-2,2-diphenyl-acetate ; Benactyzine ; Benactyzine (base and/or unspecified salts) ; 2-Diethylaminoethyl benzilate ; Benzilic acid, 2-(diethylamino)ethyl ester ; Diethylaminoethyl benzilate ; Benactyzin ; Diphenylglycolic acid 2-(diethylamino)ethyl ester .